tert-butyl (2S,5S)-4-(3-diethoxyphosphorylpropyl)-2-(hydroxymethyl)-5-propan-2-yl-piperazine-1-carboxylate

Systemtic Name: tert-butyl (2S,5S)-4-(3-diethoxyphosphorylpropyl)-2-(hydroxymethyl)-5-propan-2-yl-piperazine-1-carboxylate Openeye Name: tert-butyl (2S,5S)-4-(3-diethoxyphosphorylpropyl)-2-(hydroxymethyl)-5-isopropyl-piperazine-1-carboxylate CAS Name: (2S,5S)-4-(3-diethoxyphosphorylpropyl)-2-(hydroxymethyl)-5-propan-2-yl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5S)-4-(3-diethoxyphosphorylpropyl)-2-(hydroxymethyl)-5-propan-2-ylpiperazine-1-carboxylate Traditional Name: (2S,5S)-4-(3-diethoxyphosphorylpropyl)-5-isopropyl-2-methylol-piperazine-1-carboxylic acid tert-butyl ester Formula: C20H41N2O6P MolecularWeight: 436.523101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCN1CC(N(CC1C(C)C)C(=O)OC(C)(C)C)CO)OCC

Isomeric SMILES

CCOP(=O)(CCCN1C[C@H](N(C[C@@H]1C(C)C)C(=O)OC(C)(C)C)CO)OCC

InChI

InChI=1S/C20H41N2O6P/c1-8-26-29(25,27-9-2)12-10-11-21-13-17(15-23)22(14-18(21)16(3)4)19(24)28-20(5,6)7/h16-18,23H,8-15H2,1-7H3/t17-,18+/m0/s1